| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | X3P0CD07N8 |
| EPA CompTox | DTXSID6042444 |
Structure
| InChI Key | KKOYBOFPUBHPFO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H21O3P1S3 |
| Molecular Weight | 304.04 |
| AlogP | 3.52 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 35.53 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 10548-10-4 |
| NORMAN SUSDAT | |
| FDA SRS | X3P0CD07N8 |
| PubChem | 25355 |
| ChemSpider | 23684.0 |
CONTENTS
